SCHEMBL14029674

SCHEMBL14029674

C#CC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ CASP3 P42574 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ EPHX2 P34913 1/20 0.46
▸ MDM2 Q00987 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29398074 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29400538 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29547329 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL30695566 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL12493153 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29398455 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29552281 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL119859 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL119866 0.89 MDM4 (0.57) MDM4TP53CASP3KMT2AMDM2
SCHEMBL29688201 0.89 MDM4 (0.49) MDM4TP53CASP3KMT2AEPHX2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249106-A1 3-(1-((R)-7-((4-fluoropiperidin-1-yl)methyl)-3,4-dihydro-2H-chromen-4-yl)-1H-1,2,3-triazol-4-yl)-2-(4-methylphenylsulfonamido)propanoic acid; chronic pain analgesics; side effect reduction AMGEN INC. 2008-10-09 — — US disclosed
US-7414134-B2 B1 bradykinin receptor antagonists AMGEN INC. (US) 2008-08-19 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080249106-A1 3-(1-((R)-7-((4-fluoropiperidin-1-yl)methyl)-3,4-dihydro-2H-chromen-4-yl)-1H-1,2,3-triazol-4-yl)-2-(4-methylphenylsulfonamido)propanoic acid; chronic pain analgesics; side effect reduction BDKRB1, BDKRB2, FPR1 MDM4 4777/4885TP53 4446/4885CASP3 2103/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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